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Application

Discovery Studio 1.0 Materials Studio 0.9953843705236352 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05892857142857143 Amorphous Cell 0.2791666666666667 Blends 0.0021825396825396826 CASTEP 0.3400793650793651 CDOCKER 0.16845238095238096 CHARMm 0.2615079365079365 COMPASS 0.3492063492063492 COMPASS III 0.10257936507936508 COSMObase 0.004365079365079365 COSMOconf 0.00496031746031746 COSMOmic 1.984126984126984E-4 COSMOperm 0.001388888888888889 COSMOplex 1.984126984126984E-4 COSMOquick 7.936507936507937E-4 COSMOtherm 0.06507936507936508 Catalyst 0.09246031746031746 Classical Simulations 1.0 Conformers 3.968253968253968E-4 Crystallization 0.07281746031746032 DFTB Plus 0.005158730158730159 DMol3 0.15436507936507937 DPD 0.0025793650793650793 Discover 0.0035714285714285713 Forcite 0.533531746031746 GULP 0.019444444444444445 Kinetix 1.984126984126984E-4 LUDI 0.0031746031746031746 LibDock 0.07043650793650794 LigandFit 0.004166666666666667 MODELER 0.24226190476190476 MesoDyn 1.984126984126984E-4 Mesocite 0.002777777777777778 Mesoscale 0.005357142857142857 Modules 0.0 Morphology 0.01765873015873016 ONETEP 9.92063492063492E-4 Polymorph 0.002380952380952381 QMERA 1.984126984126984E-4 QSAR 3.968253968253968E-4 Quantum Mechanics 0.485515873015873 Reflex 0.05178571428571429 Reflex Plus 0.001388888888888889 Semi-empirical 0.006547619047619048 Sorption 0.060515873015873016 Synthia 0.0017857142857142857 TURBOMOLE 1.984126984126984E-4 VAMP 7.936507936507937E-4 Visualization 0.7464285714285714 X-Cell 0.0011904761904761906 ZDOCK 0.02757936507936508

Year

2023 0.08536770280515542 2024 0.38453373768006066 2025 1.0 2026 0.5790750568612585 2027 0.0

Keywords

target 1.0 potential 0.30383177570093456 docking 0.22271028037383178 analysis 0.21401869158878506 visualization 0.18065420560747664 between 0.14794392523364486 novel 0.09794392523364485 promising 0.0811214953271028 energy 0.08065420560747663 binding 0.07280373831775701 cell 0.06439252336448598 activity 0.055327102803738315 stability 0.04065420560747664 performance 0.035607476635514015 synthesized 0.02364485981308411 including 0.022336448598130842 development 0.0197196261682243 interaction 0.019158878504672898 effective 0.01897196261682243 experimental 0.018130841121495326 mechanism 0.01616822429906542 enhanced 0.008691588785046729 protein 0.006261682242990654 strong 0.005514018691588785 synthesis 0.0
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